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canSAR789311
FEATURES
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NAMES
    SMILES
    CO[C@H]1C(=O)N2C(C(=O)C(C)(C)C)=C(CSc3nnc(C)s3)CS(=O)(=O)[C@H]12
    InChI
    InChI=1S/C16H21N3O5S3/c1-8-17-18-15(26-8)25-6-9-7-27(22,23)14-11(24-5)13(21)19(14)10(9)12(20)16(2,3)4/h11,14H,6-7H2,1-5H3/t11-,14+/m0/s1
    MOLECULAR FORMULA
    C16H21N3O5S3
    CROSS REFERENCES
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    canSAR789311

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 431.06
    AlogP 1.42
    HBond donors 0
    HBond acceptors 8
    Atoms 48
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR789311.